4-(2-chloranylbutyl)-3-(hydroxymethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-chloranylbutyl)-3-(hydroxymethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-chlorobutyl)-3-(hydroxymethyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-chlorobutyl)-3-(hydroxymethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-chlorobutyl)-3-(hydroxymethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-chlorobutyl)-3-methylol-1H-1,2,4-triazole-5-thione Formula: C7H12ClN3OS MolecularWeight: 221.70768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C(=NNC1=S)CO)Cl

Isomeric SMILES

CCC(CN1C(=NNC1=S)CO)Cl

InChI

InChI=1S/C7H12ClN3OS/c1-2-5(8)3-11-6(4-12)9-10-7(11)13/h5,12H,2-4H2,1H3,(H,10,13)